B3O7KQ -OEChem-04022110583D 43 45 0 0 0 0 0 0 0999 V2000 5.6390 2.3585 0.0183 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.7758 1.1480 0.0026 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6834 2.7651 -0.0261 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2745 1.6926 1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2545 1.6900 -1.2611 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3116 -0.3222 0.0136 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 0.3749 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2236 1.4573 -0.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5262 -1.0097 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2462 1.3815 -0.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0322 1.2379 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5677 -3.6294 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9414 1.3563 1.2045 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9441 1.3350 -1.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2956 -1.6678 -1.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2777 -1.6615 1.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3344 1.2845 1.2068 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 1.2631 -1.2092 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0563 -5.0304 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8162 -2.9777 -1.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7985 -2.9713 1.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 0.6093 0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9592 2.0207 0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1288 -0.5953 0.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0369 2.9828 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -5.0920 -0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4111 1.3909 2.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 1.3528 -2.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4849 -1.1728 -2.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4529 -1.1618 2.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8553 1.2593 2.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8592 1.2205 -2.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4482 -5.5721 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4361 -5.5674 0.8792 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6389 -3.4789 -2.1551 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6072 -3.4677 2.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2137 -0.7214 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6992 -1.0524 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7045 -1.0358 0.9225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2531 4.0421 -0.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8913 -4.5974 0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8051 -6.1336 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -4.6021 -0.8992 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 11 1 0 0 0 0 2 24 1 0 0 0 0 3 8 1 0 0 0 0 3 25 1 0 0 0 0 6 22 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 12 20 2 0 0 0 0 12 21 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 14 18 2 0 0 0 0 14 28 1 0 0 0 0 15 20 1 0 0 0 0 15 29 1 0 0 0 0 16 21 2 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 26 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 25 2 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$